CAS Number: 7789-60-8
SMILES : BrP(Br)Br
CHEM   : Phosphorus tribromide
MOL FOR: Br3 P1 
MOL WT : 270.69
------------------------------ EPI SUMMARY (v4.10) --------------------------
 Physical Property Inputs:
    Log Kow (octanol-water):   ------
    Boiling Point (deg C)  :   ------
    Melting Point (deg C)  :   ------
    Vapor Pressure (mm Hg) :   ------
    Water Solubility (mg/L):   ------
    Henry LC (atm-m3/mole) :   ------
 
 Log Octanol-Water Partition Coef (SRC):
    *** WARNING: Inorganic Compound (Outside Estimation Domain)
    Log Kow (KOWWIN v1.68 estimate) =  2.28
 
Boiling Pt, Melting Pt, Vapor Pressure Estimations (MPBPVP v1.43):
   *** WARNING: Inorganic Compound (Outside Estimate Domain) ***
   *** WARNING: Estimations NOT VALID ***
    Boiling Pt (deg C):  570.46  (Adapted Stein & Brown method)
    Melting Pt (deg C):  237.47  (Mean or Weighted MP)
    VP(mm Hg,25 deg C):  1.34  (Mean VP of Antoine & Grain methods)
    VP (Pa, 25 deg C) :  179  (Mean VP of Antoine & Grain methods)
    MP  (exp database):  -41.5 deg C
    BP  (exp database):  173.2 deg C
 
 Water Solubility Estimate from Log Kow (WSKOW v1.42):
    *** WARNING: Inorganic Compound (Outside Estimation Domain)**
    Water Solubility at 25 deg C (mg/L):  205.3
       log Kow used: 2.28 (estimated)
       no-melting pt equation used
 
 Water Sol Estimate from Fragments:
    *** WARNING: Inorganic Compound (Outside Estimation Domain)***
    *** WARNING: Wat Sol Estimation NOT Valid ***
    Wat Sol (v1.01 est) =  9445 mg/L
 
 ECOSAR Class Program (ECOSAR v1.00):
    Class(es) found:
       Neutral Organics
 
 Henrys Law Constant (25 deg C) [HENRYWIN v3.20]:
   *** WARNING: Inorganic Compound (Outside Estimation Domain) **
   *** WARNING: Estimation NOT VALID **
   Bond Method :   1.94E-004  atm-m3/mole  (1.97E+001 Pa-m3/mole)
   Group Method:   Incomplete
 For Henry LC Comparison Purposes:
   User-Entered Henry LC:  not entered
   Henrys LC [via VP/WSol estimate using User-Entered or Estimated values]:
      HLC:  2.325E-003 atm-m3/mole  (2.356E+002 Pa-m3/mole)
      VP:   1.34 mm Hg (source: MPBPVP)
      WS:   205 mg/L (source: WSKOWWIN)
 
 Log Octanol-Air Partition Coefficient (25 deg C) [KOAWIN v1.10]:
   *** WARNING: Inorganic Compound (Outside Estimation Domain)**
   *** WARNING: Estimation NOT VALID ***
  Log Kow used:  2.28  (KowWin est)
  Log Kaw used:  -2.101  (HenryWin est)
      Log Koa (KOAWIN v1.10 estimate):  4.381
      Log Koa (experimental database):  None
 
 Probability of Rapid Biodegradation (BIOWIN v4.10):
    *** WARNING: Inorganic Compound (Outside Estimation Domain)**
    *** WARNING: Estimation NOT VALID ***
   Biowin1 (Linear Model)         :   0.6187
   Biowin2 (Non-Linear Model)     :   0.3026
 Expert Survey Biodegradation Results:
   Biowin3 (Ultimate Survey Model):   2.6010  (weeks-months)
   Biowin4 (Primary Survey Model) :   3.4572  (days-weeks  )
 MITI Biodegradation Probability:
   Biowin5 (MITI Linear Model)    :  -0.0931
   Biowin6 (MITI Non-Linear Model):   0.0050
 Anaerobic Biodegradation Probability:
   Biowin7 (Anaerobic Linear Model):  0.8361
 Ready Biodegradability Prediction:   NO
 
Hydrocarbon Biodegradation (BioHCwin v1.01):
    Structure incompatible with current estimation method!
 
 Sorption to aerosols (25 Dec C)[AEROWIN v1.00]:
  Vapor pressure (liquid/subcooled):  163 Pa (1.22 mm Hg)
  Log Koa (Koawin est  ): 4.381
   Kp (particle/gas partition coef. (m3/ug)):
       Mackay model           :  1.84E-008 
       Octanol/air (Koa) model:  5.9E-009 
   Fraction sorbed to airborne particulates (phi):
       Junge-Pankow model     :  6.66E-007 
       Mackay model           :  1.48E-006 
       Octanol/air (Koa) model:  4.72E-007 
 
 Atmospheric Oxidation (25 deg C) [AopWin v1.92]:
    *** WARNING: Inorganic Compound (Outside Estimation Domain)***
   Hydroxyl Radicals Reaction:
      OVERALL OH Rate Constant =   0.0000 E-12 cm3/molecule-sec
      Half-Life =   -------
   Ozone Reaction:
      No Ozone Reaction Estimation
   Fraction sorbed to airborne particulates (phi):
      1.07E-006 (Junge-Pankow, Mackay avg)
      4.72E-007 (Koa method)
    Note: the sorbed fraction may be resistant to atmospheric oxidation
 
 Soil Adsorption Coefficient (KOCWIN v2.00):
   *** WARNING: Inorganic Coumpound (Outside Estimation Domain) **
   *** WARNING: Estimation NOT VALID **
      Koc    :  31.82  L/kg (MCI method)
      Log Koc:  1.503       (MCI method)
      Koc    :  95.15  L/kg (Kow method)
      Log Koc:  1.978       (Kow method)
 
 Aqueous Base/Acid-Catalyzed Hydrolysis (25 deg C) [HYDROWIN v2.00]:
    Rate constants can NOT be estimated for this structure!
 
 Bioaccumulation Estimates (BCFBAF v3.01):
   Log BCF from regression-based method = 1.170 (BCF = 14.79 L/kg wet-wt)
   Log Biotransformation Half-life (HL) = -1.5310 days (HL = 0.02944 days)
   Log BCF Arnot-Gobas method (upper trophic) = 0.830 (BCF = 6.758)
   Log BAF Arnot-Gobas method (upper trophic) = 0.830 (BAF = 6.758)
       log Kow used: 2.28 (estimated)
 
 Volatilization from Water:
    Henry LC:  0.000194 atm-m3/mole  (estimated by Bond SAR Method)
    Half-Life from Model River:      6.644  hours
    Half-Life from Model Lake :      210.4  hours   (8.768 days)
 
 Removal In Wastewater Treatment:
    Total removal:              10.97  percent
    Total biodegradation:        0.09  percent
    Total sludge adsorption:     2.35  percent
    Total to Air:                8.53  percent
      (using 10000 hr Bio P,A,S)
 
 Level III Fugacity Model:
           Mass Amount    Half-Life    Emissions
            (percent)        (hr)       (kg/hr)
   Air       14.7            1e+005       1000       
   Water     31.8            900          1000       
   Soil      53.4            1.8e+003     1000       
   Sediment  0.109           8.1e+003     0          
     Persistence Time: 446 hr